N-[5-(aminocarbamoyl)-4-(4-chlorophenyl)carbonyl-cyclohexa-1,5-dien-1-yl]-3-[4-(cyclohexylcarbamothioylamino)phenyl]propanamide

Systemtic Name: N-[5-(aminocarbamoyl)-4-(4-chlorophenyl)carbonyl-cyclohexa-1,5-dien-1-yl]-3-[4-(cyclohexylcarbamothioylamino)phenyl]propanamide Openeye Name: N-[4-(4-chlorobenzoyl)-5-(hydrazinecarbonyl)cyclohexa-1,5-dien-1-yl]-3-[4-(cyclohexylcarbamothioylamino)phenyl]propanamide CAS Name: N-[4-[(4-chlorophenyl)-oxomethyl]-5-(hydrazinecarbonyl)-1-cyclohexa-1,5-dienyl]-3-[4-[[(cyclohexylamino)-sulfanylidenemethyl]amino]phenyl]propanamide IUPAC Name: N-[4-(4-chlorobenzoyl)-5-(hydrazinecarbonyl)cyclohexa-1,5-dien-1-yl]-3-[4-(cyclohexylcarbamothioylamino)phenyl]propanamide Traditional Name: N-[5-carbazoyl-4-(4-chlorobenzoyl)cyclohexa-1,5-dien-1-yl]-3-[4-(cyclohexylthiocarbamoylamino)phenyl]propionamide Formula: C30H34ClN5O3S MolecularWeight: 580.14066

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)CCC(=O)NC3=CCC(C(=C3)C(=O)NN)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)CCC(=O)NC3=CCC(C(=C3)C(=O)NN)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C30H34ClN5O3S/c31-21-11-9-20(10-12-21)28(38)25-16-15-24(18-26(25)29(39)36-32)33-27(37)17-8-19-6-13-23(14-7-19)35-30(40)34-22-4-2-1-3-5-22/h6-7,9-15,18,22,25H,1-5,8,16-17,32H2,(H,33,37)(H,36,39)(H2,34,35,40)