N-(2-carbamothioyl-4-oxidanylidene-chromen-8-yl)-4-(3-phenylbutoxy)benzamide

Systemtic Name: N-(2-carbamothioyl-4-oxidanylidene-chromen-8-yl)-4-(3-phenylbutoxy)benzamide Openeye Name: N-(2-carbamothioyl-4-oxo-chromen-8-yl)-4-(3-phenylbutoxy)benzamide CAS Name: N-(2-carbamothioyl-4-oxo-1-benzopyran-8-yl)-4-(3-phenylbutoxy)benzamide IUPAC Name: N-(2-carbamothioyl-4-oxochromen-8-yl)-4-(3-phenylbutoxy)benzamide Traditional Name: N-(4-keto-2-thiocarbamoyl-chromen-8-yl)-4-(3-phenylbutoxy)benzamide Formula: C27H24N2O4S MolecularWeight: 472.55546

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2OC(=CC3=O)C(=S)N)C4=CC=CC=C4

Isomeric SMILES

CC(CCOC1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2OC(=CC3=O)C(=S)N)C4=CC=CC=C4

InChI

InChI=1S/C27H24N2O4S/c1-17(18-6-3-2-4-7-18)14-15-32-20-12-10-19(11-13-20)27(31)29-22-9-5-8-21-23(30)16-24(26(28)34)33-25(21)22/h2-13,16-17H,14-15H2,1H3,(H2,28,34)(H,29,31)