N-[(8-fluoranyl-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]-5-methyl-thiophene-2-carboxamide

Systemtic Name: N-[(8-fluoranyl-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]-5-methyl-thiophene-2-carboxamide Openeye Name: N-[(8-fluoro-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]-5-methyl-thiophene-2-carboxamide CAS Name: N-[(8-fluoro-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]-5-methyl-2-thiophenecarboxamide IUPAC Name: N-[(8-fluoro-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]-5-methylthiophene-2-carboxamide Traditional Name: N-[(8-fluoro-1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]-5-methyl-thiophene-2-carboxamide Formula: C23H22FN3OS MolecularWeight: 407.503683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NCC2CN=C(C3=C(N2C)C=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(S1)C(=O)NCC2CN=C(C3=C(N2C)C=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C23H22FN3OS/c1-15-8-11-21(29-15)23(28)26-14-18-13-25-22(16-6-4-3-5-7-16)19-10-9-17(24)12-20(19)27(18)2/h3-12,18H,13-14H2,1-2H3,(H,26,28)