N-[(2-cyanophenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide

Systemtic Name: N-[(2-cyanophenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Openeye Name: N-[(2-cyanophenyl)carbamothioyl]-4-isopentyloxy-benzamide CAS Name: N-[(2-cyanoanilino)-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: N-[(2-cyanophenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Traditional Name: N-[(2-cyanophenyl)thiocarbamoyl]-4-isoamoxy-benzamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C#N

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C#N

InChI

InChI=1S/C20H21N3O2S/c1-14(2)11-12-25-17-9-7-15(8-10-17)19(24)23-20(26)22-18-6-4-3-5-16(18)13-21/h3-10,14H,11-12H2,1-2H3,(H2,22,23,24,26)