1-[(5-chloranyl-2-methoxy-phenyl)-(3-methylthiophen-2-yl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-chloranyl-2-methoxy-phenyl)-(3-methylthiophen-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(5-chloro-2-methoxy-phenyl)-(3-methyl-2-thienyl)methyl]-1,4-diazepane CAS Name: 1-[(5-chloro-2-methoxyphenyl)-(3-methyl-2-thiophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-chloro-2-methoxyphenyl)-(3-methylthiophen-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(5-chloro-2-methoxy-phenyl)-(3-methyl-2-thienyl)methyl]-1,4-diazepane Formula: C18H23ClN2OS MolecularWeight: 350.90602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C2=C(C=CC(=C2)Cl)OC)N3CCCNCC3

Isomeric SMILES

CC1=C(SC=C1)C(C2=C(C=CC(=C2)Cl)OC)N3CCCNCC3

InChI

InChI=1S/C18H23ClN2OS/c1-13-6-11-23-18(13)17(21-9-3-7-20-8-10-21)15-12-14(19)4-5-16(15)22-2/h4-6,11-12,17,20H,3,7-10H2,1-2H3