(E)-3-(5-methylthiophen-2-yl)-1-[(2S)-2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(5-methylthiophen-2-yl)-1-[(2S)-2-piperidin-1-ylcarbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]prop-2-en-1-one Openeye Name: (E)-3-(5-methyl-2-thienyl)-1-[(2S)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]prop-2-en-1-one CAS Name: (E)-3-(5-methyl-2-thiophenyl)-1-[(2S)-2-[oxo(1-piperidinyl)methyl]-2,3-dihydro-1,4-benzoxazin-4-yl]-2-propen-1-one IUPAC Name: (E)-3-(5-methylthiophen-2-yl)-1-[(2S)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]prop-2-en-1-one Traditional Name: (E)-3-(5-methyl-2-thienyl)-1-[(2S)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzoxazin-4-yl]prop-2-en-1-one Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=CC(=O)N2CC(OC3=CC=CC=C32)C(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=C(S1)/C=C/C(=O)N2C[C@H](OC3=CC=CC=C32)C(=O)N4CCCCC4

InChI

InChI=1S/C22H24N2O3S/c1-16-9-10-17(28-16)11-12-21(25)24-15-20(22(26)23-13-5-2-6-14-23)27-19-8-4-3-7-18(19)24/h3-4,7-12,20H,2,5-6,13-15H2,1H3/b12-11+/t20-/m0/s1