(3-chloranyl-6-ethyl-1-benzothiophen-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone

Systemtic Name: (3-chloranyl-6-ethyl-1-benzothiophen-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone Openeye Name: (3-chloro-6-ethyl-benzothiophen-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone CAS Name: (3-chloro-6-ethyl-1-benzothiophen-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone IUPAC Name: (3-chloro-6-ethyl-1-benzothiophen-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone Traditional Name: (3-chloro-6-ethyl-benzothiophen-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone Formula: C17H21ClN2OS MolecularWeight: 336.87944

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=C(S2)C(=O)N3CCCN(CC3)C)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=C(S2)C(=O)N3CCCN(CC3)C)Cl

InChI

InChI=1S/C17H21ClN2OS/c1-3-12-5-6-13-14(11-12)22-16(15(13)18)17(21)20-8-4-7-19(2)9-10-20/h5-6,11H,3-4,7-10H2,1-2H3