6-methyl-N-[5-[(3-nitrophenyl)methyl]-1,3-thiazol-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 6-methyl-N-[5-[(3-nitrophenyl)methyl]-1,3-thiazol-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 6-methyl-N-[5-[(3-nitrophenyl)methyl]thiazol-2-yl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 6-methyl-N-[5-[(3-nitrophenyl)methyl]-2-thiazolyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 6-methyl-N-[5-[(3-nitrophenyl)methyl]-1,3-thiazol-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 6-methyl-N-[5-(3-nitrobenzyl)thiazol-2-yl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H19N3O3S2 MolecularWeight: 413.51316

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC=C2C(=O)NC3=NC=C(S3)CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CCC2=C(C1)SC=C2C(=O)NC3=NC=C(S3)CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O3S2/c1-12-5-6-16-17(11-27-18(16)7-12)19(24)22-20-21-10-15(28-20)9-13-3-2-4-14(8-13)23(25)26/h2-4,8,10-12H,5-7,9H2,1H3,(H,21,22,24)