3-azanyl-7,9-dimethyl-6-prop-2-enyl-pyrido[2,3-b][1,5]benzothiazepin-5-one

Systemtic Name: 3-azanyl-7,9-dimethyl-6-prop-2-enyl-pyrido[2,3-b][1,5]benzothiazepin-5-one Openeye Name: 6-allyl-3-amino-7,9-dimethyl-pyrido[2,3-b][1,5]benzothiazepin-5-one CAS Name: 3-amino-7,9-dimethyl-6-prop-2-enyl-5-pyrido[2,3-b][1,5]benzothiazepinone IUPAC Name: 3-amino-7,9-dimethyl-6-prop-2-enylpyrido[2,3-b][1,5]benzothiazepin-5-one Traditional Name: 6-allyl-3-amino-7,9-dimethyl-pyrido[2,3-b][1,5]benzothiazepin-5-one Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC3=NC=C(C=C3C(=O)N2CC=C)N)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC3=NC=C(C=C3C(=O)N2CC=C)N)C

InChI

InChI=1S/C17H17N3OS/c1-4-5-20-15-11(3)6-10(2)7-14(15)22-16-13(17(20)21)8-12(18)9-19-16/h4,6-9H,1,5,18H2,2-3H3