3-azanyl-4-[(3,4-dimethylphenyl)amino]-5-pyrrolidin-1-yl-3H-thiophen-2-one

Systemtic Name: 3-azanyl-4-[(3,4-dimethylphenyl)amino]-5-pyrrolidin-1-yl-3H-thiophen-2-one Openeye Name: 3-amino-4-(3,4-dimethylanilino)-5-pyrrolidin-1-yl-3H-thiophen-2-one CAS Name: 3-amino-4-(3,4-dimethylanilino)-5-(1-pyrrolidinyl)-3H-thiophen-2-one IUPAC Name: 3-amino-4-(3,4-dimethylanilino)-5-pyrrolidin-1-yl-3H-thiophen-2-one Traditional Name: 3-amino-4-(3,4-dimethylanilino)-5-pyrrolidino-3H-thiophen-2-one Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C(SC(=O)C2N)N3CCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C(SC(=O)C2N)N3CCCC3)C

InChI

InChI=1S/C16H21N3OS/c1-10-5-6-12(9-11(10)2)18-14-13(17)16(20)21-15(14)19-7-3-4-8-19/h5-6,9,13,18H,3-4,7-8,17H2,1-2H3