2-azanyl-1-[3-(1,2-benzothiazol-3-ylamino)pyrrolidin-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 2-azanyl-1-[3-(1,2-benzothiazol-3-ylamino)pyrrolidin-1-yl]-3-phenyl-propan-1-one Openeye Name: 2-amino-1-[3-(1,2-benzothiazol-3-ylamino)pyrrolidin-1-yl]-3-phenyl-propan-1-one CAS Name: 2-amino-1-[3-(1,2-benzothiazol-3-ylamino)-1-pyrrolidinyl]-3-phenyl-1-propanone IUPAC Name: 2-amino-1-[3-(1,2-benzothiazol-3-ylamino)pyrrolidin-1-yl]-3-phenylpropan-1-one Traditional Name: 2-amino-1-[3-(1,2-benzothiazol-3-ylamino)pyrrolidino]-3-phenyl-propan-1-one Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC2=NSC3=CC=CC=C32)C(=O)C(CC4=CC=CC=C4)N

Isomeric SMILES

C1CN(CC1NC2=NSC3=CC=CC=C32)C(=O)C(CC4=CC=CC=C4)N

InChI

InChI=1S/C20H22N4OS/c21-17(12-14-6-2-1-3-7-14)20(25)24-11-10-15(13-24)22-19-16-8-4-5-9-18(16)26-23-19/h1-9,15,17H,10-13,21H2,(H,22,23)