(2S)-4-[2-(2,5-dimethylpyrrol-1-yl)thiophen-3-yl]carbonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-4-[2-(2,5-dimethylpyrrol-1-yl)thiophen-3-yl]carbonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-4-[2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carbonyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-4-[[2-(2,5-dimethyl-1-pyrrolyl)-3-thiophenyl]-oxomethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-4-[2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carbonyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-4-[2-(2,5-dimethylpyrrol-1-yl)thiophene-3-carbonyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=C(C=CS2)C(=O)N3CC(OC4=CC=CC=C43)C(=O)N)C

Isomeric SMILES

CC1=CC=C(N1C2=C(C=CS2)C(=O)N3C[C@H](OC4=CC=CC=C43)C(=O)N)C

InChI

InChI=1S/C20H19N3O3S/c1-12-7-8-13(2)23(12)20-14(9-10-27-20)19(25)22-11-17(18(21)24)26-16-6-4-3-5-15(16)22/h3-10,17H,11H2,1-2H3,(H2,21,24)/t17-/m0/s1