2-(aminocarbonylamino)-4-methyl-5-[4-(1-methylazepan-3-yl)oxyphenyl]thiophene-3-carboxamide

Systemtic Name: 2-(aminocarbonylamino)-4-methyl-5-[4-(1-methylazepan-3-yl)oxyphenyl]thiophene-3-carboxamide Openeye Name: 4-methyl-5-[4-(1-methylazepan-3-yl)oxyphenyl]-2-ureido-thiophene-3-carboxamide CAS Name: 2-(carbamoylamino)-4-methyl-5-[4-[(1-methyl-3-azepanyl)oxy]phenyl]-3-thiophenecarboxamide IUPAC Name: 2-(carbamoylamino)-4-methyl-5-[4-(1-methylazepan-3-yl)oxyphenyl]thiophene-3-carboxamide Traditional Name: 4-methyl-5-[4-(1-methylazepan-3-yl)oxyphenyl]-2-ureido-thiophene-3-carboxamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)N)NC(=O)N)C2=CC=C(C=C2)OC3CCCCN(C3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)N)NC(=O)N)C2=CC=C(C=C2)OC3CCCCN(C3)C

InChI

InChI=1S/C20H26N4O3S/c1-12-16(18(21)25)19(23-20(22)26)28-17(12)13-6-8-14(9-7-13)27-15-5-3-4-10-24(2)11-15/h6-9,15H,3-5,10-11H2,1-2H3,(H2,21,25)(H3,22,23,26)