N-[4-[[(4-butoxyphenyl)carbonylcarbamothioylamino]carbamoyl]phenyl]-4-tert-butyl-benzamide

Systemtic Name: N-[4-[[(4-butoxyphenyl)carbonylcarbamothioylamino]carbamoyl]phenyl]-4-tert-butyl-benzamide Openeye Name: N-[4-[[(4-butoxybenzoyl)carbamothioylamino]carbamoyl]phenyl]-4-tert-butyl-benzamide CAS Name: N-[4-[[[[[(4-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]-4-tert-butylbenzamide IUPAC Name: N-[4-[[(4-butoxybenzoyl)carbamothioylamino]carbamoyl]phenyl]-4-tert-butylbenzamide Traditional Name: N-[4-[[(4-butoxybenzoyl)thiocarbamoylamino]carbamoyl]phenyl]-4-tert-butyl-benzamide Formula: C30H34N4O4S MolecularWeight: 546.68036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C30H34N4O4S/c1-5-6-19-38-25-17-11-21(12-18-25)27(36)32-29(39)34-33-28(37)22-9-15-24(16-10-22)31-26(35)20-7-13-23(14-8-20)30(2,3)4/h7-18H,5-6,19H2,1-4H3,(H,31,35)(H,33,37)(H2,32,34,36,39)