3-bromanyl-N-[(4-phenylazanylphenyl)carbamothioyl]-4-propoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(4-phenylazanylphenyl)carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[(4-anilinophenyl)carbamothioyl]-3-bromo-4-propoxy-benzamide CAS Name: N-[(4-anilinoanilino)-sulfanylidenemethyl]-3-bromo-4-propoxybenzamide IUPAC Name: N-[(4-anilinophenyl)carbamothioyl]-3-bromo-4-propoxybenzamide Traditional Name: N-[(4-anilinophenyl)thiocarbamoyl]-3-bromo-4-propoxy-benzamide Formula: C23H22BrN3O2S MolecularWeight: 484.40868

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3)Br

InChI

InChI=1S/C23H22BrN3O2S/c1-2-14-29-21-13-8-16(15-20(21)24)22(28)27-23(30)26-19-11-9-18(10-12-19)25-17-6-4-3-5-7-17/h3-13,15,25H,2,14H2,1H3,(H2,26,27,28,30)