(E)-1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-(3-ethoxy-4-methoxy-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-(3-ethoxy-4-methoxy-phenyl)prop-2-en-1-one Openeye Name: (E)-1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-(3-ethoxy-4-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-3-(3-ethoxy-4-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-(3-ethoxy-4-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-[2-(1,3-benzothiazol-2-yl)pyrrolidino]-3-(3-ethoxy-4-methoxy-phenyl)prop-2-en-1-one Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=CC(=O)N2CCCC2C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C/C(=O)N2CCCC2C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C23H24N2O3S/c1-3-28-20-15-16(10-12-19(20)27-2)11-13-22(26)25-14-6-8-18(25)23-24-17-7-4-5-9-21(17)29-23/h4-5,7,9-13,15,18H,3,6,8,14H2,1-2H3/b13-11+