N-[[4-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[[4-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: N-[[4-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-4-isopropyl-benzamide CAS Name: N-[[4-[(N-ethylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[[4-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: N-[[4-[ethyl(phenyl)carbamoyl]phenyl]thiocarbamoyl]-4-isopropyl-benzamide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C26H27N3O2S/c1-4-29(23-8-6-5-7-9-23)25(31)21-14-16-22(17-15-21)27-26(32)28-24(30)20-12-10-19(11-13-20)18(2)3/h5-18H,4H2,1-3H3,(H2,27,28,30,32)