N-[(E)-(4-bromophenyl)methylideneamino]-4-(cyclohexylcarbamothioylamino)benzamide

Systemtic Name: N-[(E)-(4-bromophenyl)methylideneamino]-4-(cyclohexylcarbamothioylamino)benzamide Openeye Name: N-[(E)-(4-bromophenyl)methyleneamino]-4-(cyclohexylcarbamothioylamino)benzamide CAS Name: N-[(E)-(4-bromophenyl)methylideneamino]-4-[[(cyclohexylamino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-[(E)-(4-bromophenyl)methylideneamino]-4-(cyclohexylcarbamothioylamino)benzamide Traditional Name: N-[(E)-(4-bromobenzylidene)amino]-4-(cyclohexylthiocarbamoylamino)benzamide Formula: C21H23BrN4OS MolecularWeight: 459.40252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)C(=O)NN=CC3=CC=C(C=C3)Br

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)C(=O)N/N=C/C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H23BrN4OS/c22-17-10-6-15(7-11-17)14-23-26-20(27)16-8-12-19(13-9-16)25-21(28)24-18-4-2-1-3-5-18/h6-14,18H,1-5H2,(H,26,27)(H2,24,25,28)/b23-14+