(3-methylthiophen-2-yl)-[7-(pyrrolidin-1-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone

Systemtic Name: (3-methylthiophen-2-yl)-[7-(pyrrolidin-1-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Openeye Name: (3-methyl-2-thienyl)-[7-(pyrrolidin-1-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone CAS Name: (3-methyl-2-thiophenyl)-[7-(1-pyrrolidinylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone IUPAC Name: (3-methylthiophen-2-yl)-[7-(pyrrolidin-1-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Traditional Name: (3-methyl-2-thienyl)-[7-(pyrrolidinomethyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]methanone Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)N2CCOC3=C(C2)C=C(C=C3)CN4CCCC4

Isomeric SMILES

CC1=C(SC=C1)C(=O)N2CCOC3=C(C2)C=C(C=C3)CN4CCCC4

InChI

InChI=1S/C20H24N2O2S/c1-15-6-11-25-19(15)20(23)22-9-10-24-18-5-4-16(12-17(18)14-22)13-21-7-2-3-8-21/h4-6,11-12H,2-3,7-10,13-14H2,1H3