2-benzamido-N-[4-(diethylamino)phenyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-benzamido-N-[4-(diethylamino)phenyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-benzamido-N-[4-(diethylamino)phenyl]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-benzamido-N-[4-(diethylamino)phenyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-benzamido-N-[4-(diethylamino)phenyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-benzamido-N-[4-(diethylamino)phenyl]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C27H31N3O2S MolecularWeight: 461.61894

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCC(C3)C)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=O)C2=C(SC3=C2CCC(C3)C)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O2S/c1-4-30(5-2)21-14-12-20(13-15-21)28-26(32)24-22-16-11-18(3)17-23(22)33-27(24)29-25(31)19-9-7-6-8-10-19/h6-10,12-15,18H,4-5,11,16-17H2,1-3H3,(H,28,32)(H,29,31)