2-(3-methylbutoxy)-N-[[3-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 2-(3-methylbutoxy)-N-[[3-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 2-isopentyloxy-N-[[3-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide CAS Name: N-[[3-[(N-methylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-(3-methylbutoxy)benzamide IUPAC Name: 2-(3-methylbutoxy)-N-[[3-[methyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 2-isoamoxy-N-[[3-[methyl(phenyl)carbamoyl]phenyl]thiocarbamoyl]benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(C)C3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-19(2)16-17-33-24-15-8-7-14-23(24)25(31)29-27(34)28-21-11-9-10-20(18-21)26(32)30(3)22-12-5-4-6-13-22/h4-15,18-19H,16-17H2,1-3H3,(H2,28,29,31,34)