3-butoxy-N-[[4-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[4-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[4-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[4-[(N-ethylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[4-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[4-[ethyl(phenyl)carbamoyl]phenyl]thiocarbamoyl]benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N(CC)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)N(CC)C3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-3-5-18-33-24-13-9-10-21(19-24)25(31)29-27(34)28-22-16-14-20(15-17-22)26(32)30(4-2)23-11-7-6-8-12-23/h6-17,19H,3-5,18H2,1-2H3,(H2,28,29,31,34)