1-[[(E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoyl]amino]-3-phenyl-thiourea

Systemtic Name: 1-[[(E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoyl]amino]-3-phenyl-thiourea Openeye Name: 1-[[(E)-3-(4-morpholinosulfonylphenyl)prop-2-enoyl]amino]-3-phenyl-thiourea CAS Name: 1-[[(E)-3-[4-(4-morpholinylsulfonyl)phenyl]-1-oxoprop-2-enyl]amino]-3-phenylthiourea IUPAC Name: 1-[[(E)-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enoyl]amino]-3-phenylthiourea Traditional Name: 1-[[(E)-3-(4-morpholinosulfonylphenyl)acryloyl]amino]-3-phenyl-thiourea Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C=CC(=O)NNC(=S)NC3=CC=CC=C3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)NNC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O4S2/c25-19(22-23-20(29)21-17-4-2-1-3-5-17)11-8-16-6-9-18(10-7-16)30(26,27)24-12-14-28-15-13-24/h1-11H,12-15H2,(H,22,25)(H2,21,23,29)/b11-8+