1-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-prop-2-enyl-urea

Systemtic Name: 1-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-prop-2-enyl-urea Openeye Name: 1-allyl-3-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea CAS Name: 1-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-prop-2-enylurea IUPAC Name: 1-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-prop-2-enylurea Traditional Name: 1-allyl-3-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC1=CC2=C(CCN(C2)S(=O)(=O)C3=CC=CC=C3)C=C1

Isomeric SMILES

C=CCNC(=O)NC1=CC2=C(CCN(C2)S(=O)(=O)C3=CC=CC=C3)C=C1

InChI

InChI=1S/C19H21N3O3S/c1-2-11-20-19(23)21-17-9-8-15-10-12-22(14-16(15)13-17)26(24,25)18-6-4-3-5-7-18/h2-9,13H,1,10-12,14H2,(H2,20,21,23)