ethyl (E)-3-(1-methanoyl-2-phenyl-pyrrolo[2,1-b][1,3]benzothiazol-3-yl)prop-2-enoate

Systemtic Name: ethyl (E)-3-(1-methanoyl-2-phenyl-pyrrolo[2,1-b][1,3]benzothiazol-3-yl)prop-2-enoate Openeye Name: ethyl (E)-3-(1-formyl-2-phenyl-pyrrolo[2,1-b][1,3]benzothiazol-3-yl)prop-2-enoate CAS Name: (E)-3-(1-formyl-2-phenyl-3-pyrrolo[2,1-b][1,3]benzothiazolyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(1-formyl-2-phenylpyrrolo[2,1-b][1,3]benzothiazol-3-yl)prop-2-enoate Traditional Name: (E)-3-(1-formyl-2-phenyl-pyrrolo[2,1-b][1,3]benzothiazol-3-yl)acrylic acid ethyl ester Formula: C22H17NO3S MolecularWeight: 375.44028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C2N(C3=CC=CC=C3S2)C(=C1C4=CC=CC=C4)C=O

Isomeric SMILES

CCOC(=O)/C=C/C1=C2N(C3=CC=CC=C3S2)C(=C1C4=CC=CC=C4)C=O

InChI

InChI=1S/C22H17NO3S/c1-2-26-20(25)13-12-16-21(15-8-4-3-5-9-15)18(14-24)23-17-10-6-7-11-19(17)27-22(16)23/h3-14H,2H2,1H3/b13-12+