N-[(5S)-3-aminocarbonyl-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[(5S)-3-aminocarbonyl-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,3-benzothiazole-2-carboxamide Openeye Name: N-[(5S)-3-carbamoyl-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-1,3-benzothiazole-2-carboxamide CAS Name: N-[(5S)-3-carbamoyl-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[(5S)-3-carbamoyl-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1,3-benzothiazole-2-carboxamide Traditional Name: N-[(5S)-3-carbamoyl-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-1,3-benzothiazole-2-carboxamide Formula: C18H17N3O2S2 MolecularWeight: 371.47648

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=C(S2)NC(=O)C3=NC4=CC=CC=C4S3)C(=O)N

Isomeric SMILES

C[C@H]1CCC2=C(C1)C(=C(S2)NC(=O)C3=NC4=CC=CC=C4S3)C(=O)N

InChI

InChI=1S/C18H17N3O2S2/c1-9-6-7-12-10(8-9)14(15(19)22)17(24-12)21-16(23)18-20-11-4-2-3-5-13(11)25-18/h2-5,9H,6-8H2,1H3,(H2,19,22)(H,21,23)/t9-/m0/s1