N-[(E)-[1-(3-phenoxypropyl)pyrrol-2-yl]methylideneamino]-1,3-benzothiazol-2-amine

Systemtic Name: N-[(E)-[1-(3-phenoxypropyl)pyrrol-2-yl]methylideneamino]-1,3-benzothiazol-2-amine Openeye Name: N-[(E)-[1-(3-phenoxypropyl)pyrrol-2-yl]methyleneamino]-1,3-benzothiazol-2-amine CAS Name: N-[(E)-[1-(3-phenoxypropyl)-2-pyrrolyl]methylideneamino]-1,3-benzothiazol-2-amine IUPAC Name: N-[(E)-[1-(3-phenoxypropyl)pyrrol-2-yl]methylideneamino]-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-[(E)-[1-(3-phenoxypropyl)pyrrol-2-yl]methyleneamino]amine Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCN2C=CC=C2C=NNC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)OCCCN2C=CC=C2/C=N/NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N4OS/c1-2-9-18(10-3-1)26-15-7-14-25-13-6-8-17(25)16-22-24-21-23-19-11-4-5-12-20(19)27-21/h1-6,8-13,16H,7,14-15H2,(H,23,24)/b22-16+