(2-azanyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-(3,4,5-trimethoxyphenyl)methanone

Systemtic Name: (2-azanyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-(3,4,5-trimethoxyphenyl)methanone Openeye Name: (2-amino-4,5,6,7-tetrahydrobenzothiophen-3-yl)-(3,4,5-trimethoxyphenyl)methanone CAS Name: (2-amino-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-(3,4,5-trimethoxyphenyl)methanone IUPAC Name: (2-amino-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-(3,4,5-trimethoxyphenyl)methanone Traditional Name: (2-amino-4,5,6,7-tetrahydrobenzothiophen-3-yl)-(3,4,5-trimethoxyphenyl)methanone Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)C2=C(SC3=C2CCCC3)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)C2=C(SC3=C2CCCC3)N

InChI

InChI=1S/C18H21NO4S/c1-21-12-8-10(9-13(22-2)17(12)23-3)16(20)15-11-6-4-5-7-14(11)24-18(15)19/h8-9H,4-7,19H2,1-3H3