N-[3-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]phenyl]furan-2-carboxamide Openeye Name: N-[3-[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide CAS Name: N-[3-[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[3-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)amino]phenyl]furan-2-carboxamide Traditional Name: N-[3-[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]phenyl]-2-furamide Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NC3=CC=CC(=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NC3=CC=CC(=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C21H20N2O3S/c1-13-7-8-18-14(10-13)11-19(27-18)21(25)23-16-5-2-4-15(12-16)22-20(24)17-6-3-9-26-17/h2-6,9,11-13H,7-8,10H2,1H3,(H,22,24)(H,23,25)