N-[(2S)-2-(azepan-1-yl)-2-thiophen-2-yl-ethyl]-6,7-dimethyl-4-oxidanylidene-chromene-2-carboxamide

Systemtic Name: N-[(2S)-2-(azepan-1-yl)-2-thiophen-2-yl-ethyl]-6,7-dimethyl-4-oxidanylidene-chromene-2-carboxamide Openeye Name: N-[(2S)-2-(azepan-1-yl)-2-(2-thienyl)ethyl]-6,7-dimethyl-4-oxo-chromene-2-carboxamide CAS Name: N-[(2S)-2-(1-azepanyl)-2-thiophen-2-ylethyl]-6,7-dimethyl-4-oxo-1-benzopyran-2-carboxamide IUPAC Name: N-[(2S)-2-(azepan-1-yl)-2-thiophen-2-ylethyl]-6,7-dimethyl-4-oxochromene-2-carboxamide Traditional Name: N-[(2S)-2-(azepan-1-yl)-2-(2-thienyl)ethyl]-4-keto-6,7-dimethyl-chromene-2-carboxamide Formula: C24H28N2O3S MolecularWeight: 424.55572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C=C(O2)C(=O)NCC(C3=CC=CS3)N4CCCCCC4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C=C(O2)C(=O)NC[C@@H](C3=CC=CS3)N4CCCCCC4)C

InChI

InChI=1S/C24H28N2O3S/c1-16-12-18-20(27)14-22(29-21(18)13-17(16)2)24(28)25-15-19(23-8-7-11-30-23)26-9-5-3-4-6-10-26/h7-8,11-14,19H,3-6,9-10,15H2,1-2H3,(H,25,28)/t19-/m0/s1