[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(5-methyl-4-nitro-thiophen-2-yl)methanone

Systemtic Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(5-methyl-4-nitro-thiophen-2-yl)methanone Openeye Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(5-methyl-4-nitro-2-thienyl)methanone CAS Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(5-methyl-4-nitro-2-thiophenyl)methanone IUPAC Name: [4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-(5-methyl-4-nitrothiophen-2-yl)methanone Traditional Name: (5-methyl-4-nitro-2-thienyl)-(4-p-anisyl-1,4-diazepan-1-yl)methanone Formula: C19H23N3O4S MolecularWeight: 389.46862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C(=O)N2CCCN(CC2)CC3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(S1)C(=O)N2CCCN(CC2)CC3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O4S/c1-14-17(22(24)25)12-18(27-14)19(23)21-9-3-8-20(10-11-21)13-15-4-6-16(26-2)7-5-15/h4-7,12H,3,8-11,13H2,1-2H3